N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]cyclopropanecarboxamide

Systemtic Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]cyclopropanecarboxamide Openeye Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]cyclopropanecarboxamide CAS Name: N-[[3-[(2,2-dimethyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]cyclopropanecarboxamide IUPAC Name: N-[[3-(2,2-dimethylpropanoylamino)phenyl]carbamothioyl]cyclopropanecarboxamide Traditional Name: N-[[3-(pivaloylamino)phenyl]thiocarbamoyl]cyclopropanecarboxamide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2CC2

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2CC2

InChI

InChI=1S/C16H21N3O2S/c1-16(2,3)14(21)17-11-5-4-6-12(9-11)18-15(22)19-13(20)10-7-8-10/h4-6,9-10H,7-8H2,1-3H3,(H,17,21)(H2,18,19,20,22)